3-Quinuclidinone, 2-(1-naphthylmethylene)-

Base Information

• Chemical Name: 3-Quinuclidinone, 2-(1-naphthylmethylene)-
• CAS No.: 24123-91-9
• Molecular Formula: C18H17 N O
• Molecular Weight: 263.339
• UNII: 42JSX6VUZ8
• Mol file: 24123-91-9.mol

Synonyms:2-Naphthylidene-3-quinuclidinone;103660-34-0;3-Quinuclidinone, 2-(1-naphthylmethylene)-;42JSX6VUZ8;(2Z)-2-[(naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one;2-[(Z)-1-naphthylmethylidene]-3-quinuclidinone;24123-91-9;2-(1-naphthylmethylene)quinuclidin-3-one;NSC 170525;NSC-170525;UNII-42JSX6VUZ8;MFCD05256160;AKOS015993235;6X-0246;SR-01000307327;SR-01000307327-1;2-(1-Naphthalenylmethylene)-1-azabicyclo[2.2.2]octan-3-one;1-Azabicyclo[2.2.2]octan-3-one, 2-(1-naphthalenylmethylene)-

Chemical Property of 3-Quinuclidinone, 2-(1-naphthylmethylene)-

Chemical Property:

• Vapor Pressure: 2.04E-09mmHg at 25°C
• Boiling Point: 481.2°Cat760mmHg
• Flash Point: 202.7°C
• Density: 1.22g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 263.131014166
• Heavy Atom Count: 20
• Complexity: 419

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN2CCC1C(=O)C2=CC3=CC=CC4=CC=CC=C43
• Isomeric SMILES: C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43

Technology Process of 3-Quinuclidinone, 2-(1-naphthylmethylene)-

There total 4 articles about 3-Quinuclidinone, 2-(1-naphthylmethylene)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

1-azabicyclo[2.2.1]heptan-3-one (21472-89-9) + 1-naphthaldehyde (66-77-3) → 2-(1-naphthylmethylene)-3-quinuclidinone (24123-91-9)

Guidance literature:

With sodium hydroxide; In ethanol; for 12h;

DOI:10.1007/BF00515032

Reference yield: 47.0%

3-Quinuclidinone (3731-38-2) + 1-naphthaldehyde (66-77-3) → 2-(1-naphthylmethylene)-3-quinuclidinone (24123-91-9)

Guidance literature:

With potassium hydroxide; In methanol; for 24h;

DOI:10.1021/ja00083a014

Reference yield:

3-quinuclidinone hydrochloride (1193-65-3) + 1-naphthaldehyde (66-77-3) → 2-(1-naphthylmethylene)-3-quinuclidinone (24123-91-9)

Guidance literature:

3-quinuclidinone hydrochloride; With sodium hydroxide; In ethanol; water; at 20 ℃; for 0.5h;

1-naphthaldehyde; In ethanol; water; at 50 ℃; for 8h;

DOI:10.1021/acs.orglett.0c01361

upstream raw materials:

3-Quinuclidinone

1-naphthaldehyde

1-azabicyclo[2.2.1]heptan-3-one

3-quinuclidinone hydrochloride

Downstream raw materials:

4-(5-Naphthalen-1-yl-1H-pyrazol-3-yl)-piperidine